N'-methyl-4-methylsulfanyl-6-oxidanylidene-2-(4-propan-2-ylphenyl)-1-(4-sulfamoylphenyl)pyrimidine-5-carboximidamide

Systemtic Name: N'-methyl-4-methylsulfanyl-6-oxidanylidene-2-(4-propan-2-ylphenyl)-1-(4-sulfamoylphenyl)pyrimidine-5-carboximidamide Openeye Name: 2-(4-isopropylphenyl)-N'-methyl-4-methylsulfanyl-6-oxo-1-(4-sulfamoylphenyl)pyrimidine-5-carboxamidine CAS Name: N'-methyl-4-(methylthio)-6-oxo-2-(4-propan-2-ylphenyl)-1-(4-sulfamoylphenyl)-5-pyrimidinecarboximidamide IUPAC Name: N'-methyl-4-methylsulfanyl-6-oxo-2-(4-propan-2-ylphenyl)-1-(4-sulfamoylphenyl)pyrimidine-5-carboximidamide Traditional Name: 6-keto-N'-methyl-4-(methylthio)-2-p-cumenyl-1-(4-sulfamoylphenyl)pyrimidine-5-carboxamidine Formula: C22H25N5O3S2 MolecularWeight: 471.5956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=C(C(=O)N2C3=CC=C(C=C3)S(=O)(=O)N)C(=NC)N)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=C(C(=O)N2C3=CC=C(C=C3)S(=O)(=O)N)C(=NC)N)SC

InChI

InChI=1S/C22H25N5O3S2/c1-13(2)14-5-7-15(8-6-14)20-26-21(31-4)18(19(23)25-3)22(28)27(20)16-9-11-17(12-10-16)32(24,29)30/h5-13H,1-4H3,(H2,23,25)(H2,24,29,30)